7,16-diphenyl-7,16,22,26,29,32-hexazanonacyclo[18.15.0.02,17.03,15.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2(17),3(15),4,6(14),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene;7-phenyl-7,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),8,10,12,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;12-phenyl-12,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.05,13.06,11.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),6,8,10,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;13-phenyl-13,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),7,9,11,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.05,13.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),7,9,11,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.07,15.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5,7(15),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene

C211H123N29 — CID 158053064

About 7,16-diphenyl-7,16,22,26,29,32-hexazanonacyclo[18.15.0.02,17.03,15.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2(17),3(15),4,6(14),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene;7-phenyl-7,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),8,10,12,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;12-phenyl-12,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.05,13.06,11.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),6,8,10,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;13-phenyl-13,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),7,9,11,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.05,13.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),7,9,11,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.07,15.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5,7(15),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene

7,16-diphenyl-7,16,22,26,29,32-hexazanonacyclo[18.15.0.02,17.03,15.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2(17),3(15),4,6(14),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene;7-phenyl-7,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),8,10,12,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;12-phenyl-12,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.05,13.06,11.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),6,8,10,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;13-phenyl-13,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),7,9,11,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.05,13.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),7,9,11,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.07,15.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5,7(15),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene (PubChem CID 158053064) has the molecular formula C211H123N29 and a molecular weight of 3064.51 g/mol. Its IUPAC name is 7,16-diphenyl-7,16,22,26,29,32-hexazanonacyclo[18.15.0.02,17.03,15.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2(17),3(15),4,6(14),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene;7-phenyl-7,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),8,10,12,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;12-phenyl-12,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.05,13.06,11.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),6,8,10,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;13-phenyl-13,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),7,9,11,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.05,13.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),7,9,11,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.07,15.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5,7(15),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene.

Molecular Properties

• Compound Name: 7,16-diphenyl-7,16,22,26,29,32-hexazanonacyclo[18.15.0.02,17.03,15.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2(17),3(15),4,6(14),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene;7-phenyl-7,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),8,10,12,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;12-phenyl-12,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.05,13.06,11.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),6,8,10,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;13-phenyl-13,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),7,9,11,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.05,13.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),7,9,11,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.07,15.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5,7(15),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene
• PubChem CID: 158053064
• Molecular Formula: C211H123N29
• Molecular Weight: 3064.51 g/mol
• Exact Mass: 3062.05
• IUPAC Name: 7,16-diphenyl-7,16,22,26,29,32-hexazanonacyclo[18.15.0.02,17.03,15.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2(17),3(15),4,6(14),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene;7-phenyl-7,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),8,10,12,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;12-phenyl-12,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.05,13.06,11.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),6,8,10,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;13-phenyl-13,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),7,9,11,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.05,13.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),7,9,11,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.07,15.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5,7(15),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene
• SMILES: c1ccc(-n2c3ccccc3c3c2ccc2c4c5c6ccncc6n6c7cnccc7nc6c5ccc4n(-c4ccccc4)c23)cc1.c1ccc(-n2c3ccccc3c3c4c(ccc32)Cc2cc3c(cc2-4)c2ccncc2n2c4cnccc4nc32)cc1.c1ccc(-n2c3ccccc3c3cc4c(cc32)-c2cc3c5ccncc5n5c6cnccc6nc5c3cc2C4)cc1.c1ccc(-n2c3ccccc3c3cc4c(cc32)Cc2cc3c(cc2-4)c2ccncc2n2c4cnccc4nc32)cc1.c1ccc2c(c1)Cc1c-2ccc2c1-c1cc3c4ccncc4n4c5cnccc5nc4c3cc1C2.c1ccc2c(c1)Cc1c-2ccc2c1Cc1cc3c(cc1-2)c1ccncc1n1c2cnccc2nc31
• InChI: InChI=1S/C41H24N6.3C36H21N5.2C31H18N4/c1-3-9-25(10-4-1)45-32-14-8-7-13-27(32)39-34(45)17-15-29-38-33(46(40(29)39)26-11-5-2-6-12-26)18-16-30-37(38)28-19-21-42-23-35(28)47-36-24-43-22-20-31(36)44-41(30)47;1-2-6-23(7-3-1)40-32-9-5-4-8-24(32)29-15-21-14-22-16-30-28(17-26(22)27(21)18-33(29)40)25-10-12-37-19-34(25)41-35-20-38-13-11-31(35)39-36(30)41;1-2-6-23(7-3-1)40-32-9-5-4-8-24(32)29-18-27-22(16-33(29)40)14-21-15-30-28(17-26(21)27)25-10-12-37-19-34(25)41-35-20-38-13-11-31(35)39-36(30)41;1-2-6-23(7-3-1)40-30-9-5-4-8-25(30)35-31(40)11-10-21-16-22-17-28-27(18-26(22)34(21)35)24-12-14-37-19-32(24)41-33-20-38-15-13-29(33)39-36(28)41;1-2-4-20-17(3-1)12-25-21(20)6-5-18-11-19-13-26-24(14-23(19)30(18)25)22-7-9-32-15-28(22)35-29-16-33-10-8-27(29)34-31(26)35;1-2-4-19-17(3-1)11-24-20(19)5-6-21-23-14-26-22-7-9-32-15-29(22)35-30-16-33-10-8-28(30)34-31(35)27(26)13-18(23)12-25(21)24/h1-24H;2*1-13,15-20H,14H2;1-15,17-20H,16H2;2*1-10,13-16H,11-12H2
• InChIKey: FJSGWVYORKSFJT-UHFFFAOYSA-N
• XLogP: 47.99
• TPSA: 283.13 Ų
• H-Bond Acceptors: 29
• Rotatable Bonds: 5
• Heavy Atoms: 240
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3064.51
LogP ≤ 5	47.99
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	29

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 7,16-diphenyl-7,16,22,26,29,32-hexazanonacyclo[18.15.0.02,17.03,15.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2(17),3(15),4,6(14),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene;7-phenyl-7,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),8,10,12,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;12-phenyl-12,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.05,13.06,11.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),6,8,10,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;13-phenyl-13,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),7,9,11,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.05,13.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),7,9,11,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.07,15.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5,7(15),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene?

The IUPAC name of 7,16-diphenyl-7,16,22,26,29,32-hexazanonacyclo[18.15.0.02,17.03,15.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2(17),3(15),4,6(14),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene;7-phenyl-7,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),8,10,12,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;12-phenyl-12,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.05,13.06,11.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),6,8,10,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;13-phenyl-13,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),7,9,11,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.05,13.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),7,9,11,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.07,15.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5,7(15),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene (CID 158053064) is 7,16-diphenyl-7,16,22,26,29,32-hexazanonacyclo[18.15.0.02,17.03,15.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2(17),3(15),4,6(14),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene;7-phenyl-7,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),8,10,12,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;12-phenyl-12,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.05,13.06,11.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),6,8,10,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;13-phenyl-13,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),7,9,11,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.05,13.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),7,9,11,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.07,15.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5,7(15),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene.

What is the SMILES notation for 7,16-diphenyl-7,16,22,26,29,32-hexazanonacyclo[18.15.0.02,17.03,15.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2(17),3(15),4,6(14),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene;7-phenyl-7,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),8,10,12,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;12-phenyl-12,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.05,13.06,11.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),6,8,10,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;13-phenyl-13,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),7,9,11,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.05,13.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),7,9,11,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.07,15.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5,7(15),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene?

The canonical SMILES for 7,16-diphenyl-7,16,22,26,29,32-hexazanonacyclo[18.15.0.02,17.03,15.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2(17),3(15),4,6(14),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene;7-phenyl-7,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),8,10,12,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;12-phenyl-12,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.05,13.06,11.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),6,8,10,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;13-phenyl-13,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),7,9,11,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.05,13.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),7,9,11,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.07,15.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5,7(15),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene is c1ccc(-n2c3ccccc3c3c2ccc2c4c5c6ccncc6n6c7cnccc7nc6c5ccc4n(-c4ccccc4)c23)cc1.c1ccc(-n2c3ccccc3c3c4c(ccc32)Cc2cc3c(cc2-4)c2ccncc2n2c4cnccc4nc32)cc1.c1ccc(-n2c3ccccc3c3cc4c(cc32)-c2cc3c5ccncc5n5c6cnccc6nc5c3cc2C4)cc1.c1ccc(-n2c3ccccc3c3cc4c(cc32)Cc2cc3c(cc2-4)c2ccncc2n2c4cnccc4nc32)cc1.c1ccc2c(c1)Cc1c-2ccc2c1-c1cc3c4ccncc4n4c5cnccc5nc4c3cc1C2.c1ccc2c(c1)Cc1c-2ccc2c1Cc1cc3c(cc1-2)c1ccncc1n1c2cnccc2nc31.

What is the InChIKey of 7,16-diphenyl-7,16,22,26,29,32-hexazanonacyclo[18.15.0.02,17.03,15.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2(17),3(15),4,6(14),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene;7-phenyl-7,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),8,10,12,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;12-phenyl-12,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.05,13.06,11.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),6,8,10,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;13-phenyl-13,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),7,9,11,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.05,13.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),7,9,11,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.07,15.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5,7(15),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene?

The InChIKey is FJSGWVYORKSFJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H24N6.3C36H21N5.2C31H18N4/c1-3-9-25(10-4-1)45-32-14-8-7-13-27(32)39-34(45)17-15-29-38-33(46(40(29)39)26-11-5-2-6-12-26)18-16-30-37(38)28-19-21-42-23-35(28)47-36-24-43-22-20-31(36)44-41(30)47;1-2-6-23(7-3-1)40-32-9-5-4-8-24(32)29-15-21-14-22-16-30-28(17-26(22)27(21)18-33(29)40)25-10-12-37-19-34(25)41-35-20-38-13-11-31(35)39-36(30)41;1-2-6-23(7-3-1)40-32-9-5-4-8-24(32)29-18-27-22(16-33(29)40)14-21-15-30-28(17-26(21)27)25-10-12-37-19-34(25)41-35-20-38-13-11-31(35)39-36(30)41;1-2-6-23(7-3-1)40-30-9-5-4-8-25(30)35-31(40)11-10-21-16-22-17-28-27(18-26(22)34(21)35)24-12-14-37-19-32(24)41-33-20-38-15-13-29(33)39-36(28)41;1-2-4-20-17(3-1)12-25-21(20)6-5-18-11-19-13-26-24(14-23(19)30(18)25)22-7-9-32-15-28(22)35-29-16-33-10-8-27(29)34-31(26)35;1-2-4-19-17(3-1)11-24-20(19)5-6-21-23-14-26-22-7-9-32-15-29(22)35-30-16-33-10-8-28(30)34-31(35)27(26)13-18(23)12-25(21)24/h1-24H;2*1-13,15-20H,14H2;1-15,17-20H,16H2;2*1-10,13-16H,11-12H2.

What are the key properties of 7,16-diphenyl-7,16,22,26,29,32-hexazanonacyclo[18.15.0.02,17.03,15.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2(17),3(15),4,6(14),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene;7-phenyl-7,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),8,10,12,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;12-phenyl-12,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.05,13.06,11.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),6,8,10,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;13-phenyl-13,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),7,9,11,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.05,13.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),7,9,11,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.07,15.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5,7(15),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene?

7,16-diphenyl-7,16,22,26,29,32-hexazanonacyclo[18.15.0.02,17.03,15.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2(17),3(15),4,6(14),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene;7-phenyl-7,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),8,10,12,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;12-phenyl-12,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.05,13.06,11.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),6,8,10,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;13-phenyl-13,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),7,9,11,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.05,13.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),7,9,11,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.07,15.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5,7(15),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene has a molecular weight of 3064.51 g/mol, XLogP of 47.99, 5 rotatable bonds, 0 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for 7,16-diphenyl-7,16,22,26,29,32-hexazanonacyclo[18.15.0.02,17.03,15.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2(17),3(15),4,6(14),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene;7-phenyl-7,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),8,10,12,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;12-phenyl-12,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.05,13.06,11.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),6,8,10,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;13-phenyl-13,22,26,29,32-pentazanonacyclo[18.15.0.03,18.04,16.06,14.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4,6(14),7,9,11,15,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.05,13.07,12.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5(13),7,9,11,14,18,21,23(28),24,26,30(35),31,33-hexadecaene;22,26,29,32-tetrazanonacyclo[18.15.0.03,18.04,16.07,15.08,13.021,29.023,28.030,35]pentatriaconta-1(20),2,4(16),5,7(15),8,10,12,18,21,23(28),24,26,30(35),31,33-hexadecaene is sourced from PubChem (CID 158053064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).